| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(N1CCCC(C1)C(N)=O)c1[NH]ncc1Br |
| InChI | InChI | 1.06 | InChI=1S/C10H13BrN4O2/c11-7-4-13-14-8(7)10(17)15-3-1-2-6(5-15)9(12)16/h4,6H,1-3,5H2,(H2,12,16)(H,13,14)/t6-/m0/s1 |
| InChIKey | InChI | 1.06 | UUCCVHLCPSLNLR-LURJTMIESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)[C@H]1CCCN(C1)C(=O)c2[nH]ncc2Br |
| SMILES | CACTVS | 3.385 | NC(=O)[CH]1CCCN(C1)C(=O)c2[nH]ncc2Br |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1c(c([nH]n1)C(=O)N2CCC[C@@H](C2)C(=O)N)Br |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1c(c([nH]n1)C(=O)N2CCCC(C2)C(=O)N)Br |
